SCHEMBL790648

SCHEMBL790648

O=S(=O)(NCCCCN1CCN(c2cccc3c2OCCO3)CC1)c1ccc(F)c(Cl)c1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR7 P34969 8/20 0.59
HTR6 P50406 7/20 0.59
DRD2 P14416 6/20 0.59
HTR2A P28223 6/20 0.59
HTR1A P08908 6/20 0.58
DRD3 P35462 2/20 0.58
DRD4 P21917 1/20 0.58
ADRA1D P25100 1/20 0.58
ADRA1A P35348 1/20 0.58
ADRA1B P35368 1/20 0.58
PKM P14618 1/20 0.50
PKLR P30613 1/20 0.50
FAAH O00519 1/20 0.49
CNR1 P21554 1/20 0.49

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL792618 0.92 HTR1A (0.57) HTR7DRD2HTR1ADRD3DRD4
SCHEMBL790903 0.90 HTR7 (0.55) HTR7HTR6DRD2HTR2AHTR1A
SCHEMBL791927 0.89 HTR7 (0.58) HTR7HTR1ADRD4ADRA1APKM
SCHEMBL792716 0.88 CCR1 (0.53) HTR7HTR6DRD2HTR2AHTR1A
SCHEMBL791913 0.88 HTR7 (0.62) HTR7HTR6DRD2HTR2AHTR1A
SCHEMBL790850 0.88 HTR1A (0.61) HTR7DRD2HTR2AHTR1ADRD3
SCHEMBL792144 0.86 HTR1A (0.54) DRD2HTR2AHTR1ADRD3DRD4
SCHEMBL790747 0.85 HTR7 (0.58) HTR7HTR6DRD2HTR2AHTR1A
SCHEMBL793365 0.85 HTR1A (0.66) HTR7HTR6DRD2HTR2AHTR1A
SCHEMBL790804 0.85 HTR1A (0.57) HTR7DRD2HTR1ADRD3DRD4

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2616440-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES Adamed sp. z o.o. (PL) 2013-07-24 EP claimed
US-20130172365-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z.O.O. (PL) 2013-07-04 US claimed
WO-2012035123-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z O.O. (PL) 2012-03-22 WO claimed
US-9120767-B2 Arylosulfonamides for the treatment of CNS diseases ADAMED SP. Z.O.O. (PL) 2015-09-01 US disclosed
US-20140336200-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z O.O. (PL) 2014-11-13 US disclosed
US-8822517-B2 Arylosulfonamides for the treatment of CNS diseases ADAMED SP. Z O.O. (PL) 2014-09-02 US disclosed
EP-2616440-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES Adamed sp. z o.o. (PL) 2013-07-24 EP disclosed
US-20130172365-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z.O.O. (PL) 2013-07-04 US disclosed
WO-2012035123-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ADAMED SP. Z O.O. (PL) 2012-03-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140336200-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ARSA, PMP22, STS HTR7 1419/4885HTR6 1131/4885DRD2 3216/4885
US-20130172365-A1 ARYLOSULFONAMIDES FOR THE TREATMENT OF CNS DISEASES ARSA, PMP22, STS HTR7 1419/4885HTR6 1131/4885DRD2 3216/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.